SCHEMBL585988

SCHEMBL585988

C#CCC(=O)OCl

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL775163 0.75 ALDH1A1 (0.36)
SCHEMBL28110144 0.74
SCHEMBL1481797 0.71
SCHEMBL6971162 0.71
SCHEMBL243682 0.71
SCHEMBL6423396 0.71 DGKA (0.36)
SCHEMBL10010450 0.69
SCHEMBL7627037 0.67 TSHR (0.44)
SCHEMBL3985200 0.67
SCHEMBL1140911 0.67

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015007613-A1 O-ALKYL TRIAZOLYL CARBAMATES AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE (FAAH) FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2015-01-22 WO disclosed
EP-2691373-A1 3-UREIDOISOQUINOLIN-8-YL DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2014-02-05 EP disclosed
WO-2012131588-A1 3-UREIDOISOQUINOLIN-8-YL DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2012-10-04 WO disclosed
WO-2012075117-A2 SMALL MOLECULE-POLYMER CONJUGATES AND METHODS OF MAKING SAME ABLITECH, INC. (US) 2012-06-07 WO disclosed
WO-2012075114-A2 NUCLEIC ACID-POLYMER CONJUGATES AND USES THEREOF ABLITECH, INC. (US) 2012-06-07 WO disclosed
EP-2437789-A1 BIOMOLECULE-POLYMER CONJUGATES AND METHODS OF MAKING SAME Ablitech, Inc. (US) 2012-04-11 EP disclosed
EP-2417172-A1 DIBLOCK COPOLYMER MODIFIED NANOPARTICLE/POLYMER COMPOSITES RENSSELAER POLYTECHNIC INSTITUTE (US) 2012-02-15 EP disclosed
WO-2010141507-A1 BIOMOLECULE-POLYMER CONJUGATES AND METHODS OF MAKING SAME ABLITECH, INC. (US) 2010-12-09 WO disclosed
WO-2010118343-A1 DIBLOCK COPOLYMER MODIFIED NANOPARTICLE/POLYMER COMPOSITES RENSSELAER POLYTECHNIC INSTITUTE (US) 2010-10-14 WO disclosed
EP-2059516-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (publ) (SE) 2009-05-20 EP disclosed
WO-2008025798-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 WO disclosed